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Programs for calculating the molecular electrostatic potential

โœ Scribed by V. Ya. Artyukhov


Publisher
SP MAIK Nauka/Interperiodica
Year
1978
Tongue
English
Weight
402 KB
Volume
19
Category
Article
ISSN
0022-4766

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๐Ÿ“œ SIMILAR VOLUMES


Calculation of molecular electrostatic p
โœ J.C. Culberson; Michael C. Zerner ๐Ÿ“‚ Article ๐Ÿ“… 1985 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 411 KB

Original auempls 10 calculate elecrrosIatic pmenlials (EPs) from semi-empirical wavcfumxions okn railed IO march either ;:b initio calculations or rcsulrs inferred from experiment. We rs-cxnmine this problem for benzene and cylosine. LWO or rhe molecules which led 10 the demise or EP studies using w